2-(6-azanyl-2,4-dimethyl-pyrimidin-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone bromide

Systemtic Name: 2-(6-azanyl-2,4-dimethyl-pyrimidin-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone bromide Openeye Name: 2-(6-amino-2,4-dimethyl-pyrimidin-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone bromide CAS Name: 2-(6-amino-2,4-dimethyl-1-pyrimidin-1-iumyl)-1-(4-methoxyphenyl)ethanone bromide IUPAC Name: 2-(6-amino-2,4-dimethylpyrimidin-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone bromide Traditional Name: 2-(6-amino-2,4-dimethyl-pyrimidin-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone bromide Formula: C15H18BrN3O2 MolecularWeight: 352.22632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](C(=N1)C)CC(=O)C2=CC=C(C=C2)OC)N.[Br-]

Isomeric SMILES

CC1=CC(=[N+](C(=N1)C)CC(=O)C2=CC=C(C=C2)OC)N.[Br-]

InChI

InChI=1S/C15H17N3O2.BrH/c1-10-8-15(16)18(11(2)17-10)9-14(19)12-4-6-13(20-3)7-5-12;/h4-8,16H,9H2,1-3H3;1H